2-[4-[2,6-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]-N-pentyl-ethanamide

Systemtic Name: 2-[4-[2,6-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]-N-pentyl-ethanamide Openeye Name: 2-[4-(2,6-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-pentyl-acetamide CAS Name: 2-[4-(2,6-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-pentylacetamide IUPAC Name: 2-[4-(2,6-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-pentylacetamide Traditional Name: N-amyl-2-[4-(2,6-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C17H26Cl2N3O3S+ MolecularWeight: 423.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CCCCCNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C17H25Cl2N3O3S/c1-2-3-4-8-20-16(23)13-21-9-11-22(12-10-21)26(24,25)17-14(18)6-5-7-15(17)19/h5-7H,2-4,8-13H2,1H3,(H,20,23)/p+1